6,6,6-TRIFLUORONORLEUCINE

The Norleucine,6,6,6-trifluoro-, with the CAS registry number of 120200-04-6, is also known as 6,6,6-Trifluoronorleucine. This chemical's molecular formula is C₆H₁₀F₃NO₂ and molecular weight is 185.14. What's more, its IUPAC name is 2-Amino-6,6,6-trifluorohexanoic acid.

Physical properties about the Norleucine,6,6,6-trifluoro- are: (1)ACD/LogP: -0.07; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 29.54 Å²; (11)Index of Refraction: 1.41; (12)Molar Refractivity: 35.36 cm³; (13)Molar Volume: 142.6 cm³; (14)Surface Tension: 33.3 dyne/cm; (15)Density: 1.297 g/cm³; (16)Flash Point: 89.9 °C; (17)Enthalpy of Vaporization: 50.85 kJ/mol; (18)Boiling Point: 225.1 °C at 760 mmHg; (19)Vapour Pressure: 0.0322 mmHg at 25 °C.

Preparation: this chemical is prepared by N-Benzoyl-6,6,6-trifluoronorleucine ethyl ester. The reaction needs reagent HCl. The reaction time is 20 h. The yield is about 71 %.

Uses: it is used to produce other chemicals. For example, it is used to produce N-Acetyl-6,6,6-trifluoronorleucine. This reaction needs reagent Sodium hydroxide. Meanwhile, it needs solvent H₂O. The reaction time is 30 min. The yield is about 71 %.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)CCCC(N)C(=O)O
(2) InChI: InChI=1/C6H10F3NO2/c7-6(8,9)3-1-2-4(10)5(11)12/h4H,1-3,10H2,(H,11,12)
(3) InChIKey: RUEWGWBXZIDRJY-UHFFFAOYAC